SCHEMBL8998709

SCHEMBL8998709

NC(=O)C(=NOc1ccccc1)Oc1ccccc1

nearest known ligand 0.43

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
USP2 O75604 1/20 0.43
PRSS1 P07477 2/20 0.42
TMPRSS15 P98073 2/20 0.42
ACR P10323 1/20 0.42
TDP1 Q9NUW8 2/20 0.40
PARP10 Q53GL7 2/20 0.40
MAPT P10636 2/20 0.40
PRSS2 P07478 1/20 0.40
PRSS3 P35030 1/20 0.40
KDM4E B2RXH2 1/20 0.40
HPGD P15428 2/20 0.39
SMN1; SMN2 Q16637 1/20 0.39
ATM Q13315 1/20 0.39
L3MBTL1 Q9Y468 1/20 0.39
MEN1 O00255 1/20 0.38
KMT2A Q03164 1/20 0.38
ALOX15 P16050 1/20 0.38
HSD17B10 Q99714 1/20 0.38
ALDH1A1 P00352 2/20 0.38
CTNNB1 P35222 1/20 0.37

Click a target to see other patent compounds predicted against it — the reverse direction, in place.

Similar compounds — the chemically nearest patent molecules

Nearest neighbours by Morgan-fingerprint cosine across the patent-compound collection, with each neighbour's top predicted target and the predicted targets it shares with this molecule.

Compoundsimilaritytop predictedshared targets
SCHEMBL2257828 0.73 HTR3E (0.42) USP2PRSS1TMPRSS15ACRPARP10
SCHEMBL4869116 0.71 PARP10 (0.47) USP2PRSS1TMPRSS15ACRTDP1
Carbamic Acid Phenyl Ester SCHEMBL7566 0.71 MEN1 (0.70) USP2PRSS1TMPRSS15ACRTDP1
Carbamic Acid Phenyl Ester SCHEMBL5447519 0.69 MEN1 (0.67) USP2PRSS1TMPRSS15ACRTDP1
Carbamic Acid Phenyl Ester SCHEMBL28935973 0.69 MEN1 (0.67) USP2PRSS1TMPRSS15ACRTDP1
Carbamic Acid Phenyl Ester SCHEMBL11792763 0.69 MEN1 (0.67) USP2PRSS1TMPRSS15ACRTDP1
Carbamic Acid Phenyl Ester SCHEMBL17144965 0.69 MEN1 (0.67) USP2PRSS1TMPRSS15ACRTDP1
Carbamic Acid Phenyl Ester SCHEMBL11627152 0.69 MEN1 (0.67) USP2PRSS1TMPRSS15ACRTDP1
SCHEMBL707493 0.68 PARP10 (0.44) USP2PRSS1TMPRSS15ACRTDP1
SCHEMBL4662559 0.68 PARP10 (0.44) USP2PRSS1TMPRSS15ACRTDP1

Similarity is cosine over the 2,048-bit Morgan fingerprint (≈ Tanimoto). Identical fingerprints score 1.00.

Patent provenance — the patents this molecule appears in, and who filed them

Claimed or disclosed in 2 patents. claimed = in the patent's claims; disclosed = body only.

PatentTitleAssigneePublishedPriorityFilingCountryStatus
JP-8231310-A None JP disclosed
JP-H08231310-A MICROBICIDAL AGENT FOR AGRICULTURAL PURPOSE SHIONOGI & CO LTD 1996-09-10 JP disclosed